(Z)-2-amino-4-phenylhept-4-en-1-ol

C13H19NO — CID 170892101

IUPAC(Z)-2-amino-4-phenylhept-4-en-1-ol
SMILESCC/C=C(/CC(N)CO)c1ccccc1
InChIInChI=1S/C13H19NO/c1-2-6-12(9-13(14)10-15)11-7-4-3-5-8-11/h3-8,13,15H,2,9-10,14H2,1H3/b12-6-
InChIKeyYVKGXBQQIKSYGG-SDQBBNPISA-N
MW205.30 g/mol
LogP2.19
Rot. Bonds5

About (Z)-2-amino-4-phenylhept-4-en-1-ol

(Z)-2-amino-4-phenylhept-4-en-1-ol (PubChem CID 170892101) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (Z)-2-amino-4-phenylhept-4-en-1-ol.

Molecular Properties

Compound Name(Z)-2-amino-4-phenylhept-4-en-1-ol
PubChem CID170892101
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(Z)-2-amino-4-phenylhept-4-en-1-ol
SMILESCC/C=C(/CC(N)CO)c1ccccc1
InChIInChI=1S/C13H19NO/c1-2-6-12(9-13(14)10-15)11-7-4-3-5-8-11/h3-8,13,15H,2,9-10,14H2,1H3/b12-6-
InChIKeyYVKGXBQQIKSYGG-SDQBBNPISA-N
XLogP2.19
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-amino-4-phenylhept-4-en-1-ol?
The IUPAC name of (Z)-2-amino-4-phenylhept-4-en-1-ol (CID 170892101) is (Z)-2-amino-4-phenylhept-4-en-1-ol.
What is the SMILES notation for (Z)-2-amino-4-phenylhept-4-en-1-ol?
The canonical SMILES for (Z)-2-amino-4-phenylhept-4-en-1-ol is CC/C=C(/CC(N)CO)c1ccccc1.
What is the InChIKey of (Z)-2-amino-4-phenylhept-4-en-1-ol?
The InChIKey is YVKGXBQQIKSYGG-SDQBBNPISA-N. The full InChI is InChI=1S/C13H19NO/c1-2-6-12(9-13(14)10-15)11-7-4-3-5-8-11/h3-8,13,15H,2,9-10,14H2,1H3/b12-6-.
What are the key properties of (Z)-2-amino-4-phenylhept-4-en-1-ol?
(Z)-2-amino-4-phenylhept-4-en-1-ol has a molecular weight of 205.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-amino-4-phenylhept-4-en-1-ol is sourced from PubChem (CID 170892101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).